CID 2755980

955016-25-8

Structural Information

Molecular Formula
C11H19NO5
SMILES
CC(C)(C)OC(=O)N1CC[C@H](C[C@H]1C(=O)O)O
InChI
InChI=1S/C11H19NO5/c1-11(2,3)17-10(16)12-5-4-7(13)6-8(12)9(14)15/h7-8,13H,4-6H2,1-3H3,(H,14,15)/t7-,8+/m1/s1
InChIKey
GCAZZUFIDGXTDA-SFYZADRCSA-N
Compound name
(2S,4R)-4-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

69
Patents

245.12633 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.13361 154.8
[M+Na]+ 268.11555 159.7
[M-H]- 244.11905 153.9
[M+NH4]+ 263.16015 169.6
[M+K]+ 284.08949 159.2
[M+H-H2O]+ 228.12359 149.4
[M+HCOO]- 290.12453 168.0
[M+CH3COO]- 304.14018 187.3
[M+Na-2H]- 266.10100 155.6
[M]+ 245.12578 152.7
[M]- 245.12688 152.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe